Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one
TL;DR: Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one (CAS 201294-78-2) is a chemical compound with molecular formula C12H14OS and molecular weight 206.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-phenylthian-4-one
Also Known As: 3-methyl-2-phenylthian-4-one, 3-methyl-2-phenyltetrahydro-4-thiopyranone, 4H-Thiopyran-4-one, tetrahydro-, 3-methyl-2-phenyl-, Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one, 3-methyl-2-phenyldihydro-2H-thiopyran-4(3H)-one
| Molecular Formula | C12H14OS |
|---|---|
| Molecular Weight | 206.08 g/mol |
| LogP | 3.0698 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 206.07654 |
| Heavy Atoms | 14 |
| Complexity | 320.35342 |
Chemical Identifiers
| CAS Number | 201294-78-2 |
|---|---|
| SMILES | CC1C(SCCC1=O)C2=CC=CC=C2 |
Product Overview
Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one (CAS 201294-78-2), with molecular formula C12H14OS and molecular weight 206.08 g/mol. IUPAC: 3-methyl-2-phenylthian-4-one.
Chemical Property Profile of Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one
Property Insights of Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one
The XLogP value of 3.0698 indicates that Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one?
The CAS number of Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one is 201294-78-2.
What is the molecular formula of Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one?
The molecular formula of Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one is C12H14OS.
What is the molecular weight of Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one?
The molecular weight of Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one is 206.08 g/mol.
Where can I buy Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one?
You can request a quote for Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one?
Yes, KEHONG BIO provides custom synthesis services for Tetrahydro-3-methyl-2-phenyl-4H-thiopyran-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.